2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine

C17H22N2O — CID 62296801

IUPAC2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine
SMILESCc1ccccc1Oc1ncccc1CNCC(C)C
InChIInChI=1S/C17H22N2O/c1-13(2)11-18-12-15-8-6-10-19-17(15)20-16-9-5-4-7-14(16)3/h4-10,13,18H,11-12H2,1-3H3
InChIKeyPGQFIHHEQQSAJX-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.93
Rot. Bonds6

About 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine

2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine (PubChem CID 62296801) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine
PubChem CID62296801
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine
SMILESCc1ccccc1Oc1ncccc1CNCC(C)C
InChIInChI=1S/C17H22N2O/c1-13(2)11-18-12-15-8-6-10-19-17(15)20-16-9-5-4-7-14(16)3/h4-10,13,18H,11-12H2,1-3H3
InChIKeyPGQFIHHEQQSAJX-UHFFFAOYSA-N
XLogP3.93
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine with MolForge

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Related Compounds

N-[[2-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 64854495
N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]-1-pyridin-3-ylmethanamine
CID 42198890
2-methyl-N-[[6-methyl-4-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine
CID 81253703
2-methyl-N-[[2-(3-methylbutoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62290330
N-[[2-(4-bromo-2-fluorophenoxy)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62323270
2-methyl-N-[(2-octoxy-3-pyridinyl)methyl]propan-1-amine
CID 63488126
4-methoxy-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]pyrimidin-2-amine
CID 56744605
N-[[5-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-1-[2-(2-methylphenoxy)-3-pyridinyl]methanamine
CID 42519423
(2S)-1-[(2-methoxy-3-pyridinyl)methylamino]propan-2-ol
CID 106931879
N-[[2-(2,5-dimethylphenoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62296784
N-[[2-(5-bromo-2-methylphenoxy)phenyl]methyl]-2-methylpropan-1-amine
CID 107285197
2-methyl-N-[[2-(oxan-2-ylmethoxy)-3-pyridinyl]methyl]propan-1-amine
CID 62291392

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine (CID 62296801) is 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine is Cc1ccccc1Oc1ncccc1CNCC(C)C.
What is the InChIKey of 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine?
The InChIKey is PGQFIHHEQQSAJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-13(2)11-18-12-15-8-6-10-19-17(15)20-16-9-5-4-7-14(16)3/h4-10,13,18H,11-12H2,1-3H3.
What are the key properties of 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine?
2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine has a molecular weight of 270.38 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(2-methylphenoxy)-3-pyridinyl]methyl]propan-1-amine is sourced from PubChem (CID 62296801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).